CAS RN: 5667-20-9

6-N-HYDROXYLAMINOPURINE

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4 package records4 with current stock2 grade groups
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Batchno.20250202 25mg In stock Shanghai Inquiry
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Batchno.20250419 100mg In stock Shanghai Inquiry
Batchno.20251204 25mg In stock Shanghai Inquiry
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  • Product code: starshine_CAS5667-20-9
  • Purity/Analytical Methods: >99.0%
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5667-20-9 / N-(7H-purin-6-yl)hydroxylamine

Standard CAS: 5667-20-9 Multi CAS: Yes

Basic Information

CAS
5667-20-9
Multi CAS
Yes
Molecular Formula
C5H5N5O
Molecular Weight
151.130000
Exact Mass
151.049410
InChI
InChI=1S/C5H5N5O/c11-10-5-3-4(7-1-6-3)8-2-9-5/h1-2,11H,(H2,6,7,8,9,10)
InChIKey
CBCQWVQNMGNYEO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
3
Molar refractivity
37.09
TPSA
86.72

LogP / Solubility

WLOGP
0.15
MLOGP
0.13
XLogP3
0.1
Consensus LogP
0.13
Log S (ESOL)
-1.41
Class (ESOL)
Soluble
Log S (Ali)
-0.91
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.89
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.53

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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